CID 215375

Urea, n-(4-nitrophenyl)-n'-2-oxazolyl-

Structural Information

Molecular Formula
C10H8N4O4
SMILES
C1=CC(=CC=C1NC(=O)NC2=NC=CO2)[N+](=O)[O-]
InChI
InChI=1S/C10H8N4O4/c15-9(13-10-11-5-6-18-10)12-7-1-3-8(4-2-7)14(16)17/h1-6H,(H2,11,12,13,15)
InChIKey
NFNMBVGVKBNQEC-UHFFFAOYSA-N
Compound name
1-(4-nitrophenyl)-3-(1,3-oxazol-2-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.05455 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.06183 148.7
[M+Na]+ 271.04377 154.1
[M-H]- 247.04727 155.2
[M+NH4]+ 266.08837 162.8
[M+K]+ 287.01771 149.2
[M+H-H2O]+ 231.05181 144.7
[M+HCOO]- 293.05275 175.5
[M+CH3COO]- 307.06840 187.6
[M+Na-2H]- 269.02922 158.1
[M]+ 248.05400 147.0
[M]- 248.05510 147.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe